[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-[1-(4-pyridyl)-4-piperidyl]methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-(1-pyridin-4-yl-4-piperidinyl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone Traditional Name: (4-brosylpiperazino)-[1-(4-pyridyl)-4-piperidyl]methanone Formula: C21H25BrN4O3S MolecularWeight: 493.4172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=NC=C4

InChI

InChI=1S/C21H25BrN4O3S/c22-18-1-3-20(4-2-18)30(28,29)26-15-13-25(14-16-26)21(27)17-7-11-24(12-8-17)19-5-9-23-10-6-19/h1-6,9-10,17H,7-8,11-16H2